[1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine

C12H17ClN4S — CID 105312710

IUPAC[1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
SMILESCC(C)n1ccc(CC(NN)c2ccc(Cl)s2)n1
InChIInChI=1S/C12H17ClN4S/c1-8(2)17-6-5-9(16-17)7-10(15-14)11-3-4-12(13)18-11/h3-6,8,10,15H,7,14H2,1-2H3
InChIKeyUCRZDVZNUYOWMZ-UHFFFAOYSA-N
MW284.82 g/mol
LogP2.93
Rot. Bonds5

About [1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine

[1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine (PubChem CID 105312710) has the molecular formula C12H17ClN4S and a molecular weight of 284.82 g/mol. Its IUPAC name is [1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
PubChem CID105312710
Molecular FormulaC12H17ClN4S
Molecular Weight284.82 g/mol
Exact Mass284.09
IUPAC Name[1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
SMILESCC(C)n1ccc(CC(NN)c2ccc(Cl)s2)n1
InChIInChI=1S/C12H17ClN4S/c1-8(2)17-6-5-9(16-17)7-10(15-14)11-3-4-12(13)18-11/h3-6,8,10,15H,7,14H2,1-2H3
InChIKeyUCRZDVZNUYOWMZ-UHFFFAOYSA-N
XLogP2.93
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.82
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[2-(1-butan-2-ylpyrazol-3-yl)-1-(5-chlorothiophen-2-yl)ethyl]propan-1-amine
CID 104989613
[1-(5-chlorothiophen-2-yl)-2-(1-methylimidazol-2-yl)ethyl]hydrazine
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[1-(2-chloro-3-fluorophenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105312731
[1-(2-chloro-4-fluorophenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105215278
[2-(1-methylpyrazol-3-yl)-1-(5-methylthiophen-2-yl)ethyl]hydrazine
CID 105329473
[1-(5-chlorothiophen-2-yl)-2-(5-ethyl-2-pyridinyl)ethyl]hydrazine
CID 105324371
[1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105222106
[1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105312734
[1-(5-ethylthiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105329455
[1-(2,5-dibromophenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105312747
[2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5-chlorothiophen-2-yl)ethyl]hydrazine
CID 105316820
[1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine
CID 105195292

Frequently Asked Questions

What is the IUPAC name of [1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine?
The IUPAC name of [1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine (CID 105312710) is [1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine is CC(C)n1ccc(CC(NN)c2ccc(Cl)s2)n1.
What is the InChIKey of [1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine?
The InChIKey is UCRZDVZNUYOWMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN4S/c1-8(2)17-6-5-9(16-17)7-10(15-14)11-3-4-12(13)18-11/h3-6,8,10,15H,7,14H2,1-2H3.
What are the key properties of [1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine?
[1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine has a molecular weight of 284.82 g/mol, XLogP of 2.93, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-chlorothiophen-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105312710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).